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CS-W001157 4
Total: USD 88.00

(E)-3-(3-Methylthiophen-2-yl)acrylic acid

  • CAS No. 102696-70-8

  • Cat. No. CS-0076566
  • Molecule weight168.21
  • Purity≥96%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

(E)-3-(3-Methylthiophen-2-yl)acrylic acid|CS-0076566

Structure of 102696-70-8

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General Information

  • CAS No. 102696-70-8
  • Cat. No. CS-0076566
  • Purity ≥96%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈O₂S
  • Molecular Weight 168.21
  • Synonym(s) 3-(3-methylthiophen-2-yl)-propenoic acid
  • SMILES O=C(O)/C=C/C1=C(C)C=CS1

Synthesis

  • Route1
    • In-stock
      3-Methyl-2-thiophenecarboxaldehyde ,tech|CS-0071758
      5834-16-2
    • null|null
      141-82-2
    • ~88%
    • In-stock
      (E)-3-(3-Methylthiophen-2-yl)acrylic acid|CS-0076566
      102696-70-8

    References

    • VICURON PHARMACEUTICALS INC. Patent: US2006/211603 A1, 2006 ; Location in patent: Page/Page column 39; 47-48 ;
  • Route2

    References

    • King; Nord Journal of Organic Chemistry, 1949 , vol. 14, p. 405,409
  • Route3
    • Ethyl 3-(3-methylthiophen-2-yl)acrylate|CS-0942979
      133933-41-2
    • ~%
    • In-stock
      (E)-3-(3-Methylthiophen-2-yl)acrylic acid|CS-0076566
      102696-70-8

    References

    • Aitken, R. Alan; Boeters, Christine; Morrison, John J. Journal of the Chemical Society - Perkin Transactions 1, 1997 , # 17 p. 2625 - 2631

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.15432
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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